5-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)-(2-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Formula:C15H10N4O7 Mutagenic:low Tumorigenic:none Reproductive Effective:high 5-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)-(2-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is not a drug-like molecule.

MolName	5-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)-(2-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C15H10N4O7
Smiles	Oc(cccc1)c1C(C(C(NC(N1)=O)=O)=C1O)=C(C(NC(N1)=O)=O)C1=O
InChI	InChI=1S/C15H10N4O7/c20-6-4-2-1-3-5(6)7(8-10(21)16-14(25)17-11(8)22)9-12(23)18-15(26)19-13(9)24/h1-4,20H,(H2,16,17,21,22,25)(H3,18,19,23,24,26)
InChIK	MPSCJERVIVHVIE-UHFFFAOYSA-N
TotalMolweight	358.265
Molweight	358.265
MonoisotopicMass	358.054951
CLogP	-1.1061
CLogS	-3.22
H Acceptors	11
H Donors	6
TotalSurfaceArea	239.39
Relative PSA	0.57329
PolarSurfaceArea	173.93
Druglikeness	4.3444
Mutagenic	low
Tumorigenic	none
Reproductive Effective	high
Irritant	high
Nasty Functions	polar activated DB; twice activated DB
Shape Index	0.42308
Fragments	1
Non HAtoms	26
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	2
Symmetricatoms	3
Amides	4
StereoCon

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